{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.1192774 -59.9256951 -319.2900277 ] [ -54.3768245 68.9488534 323.3629479 ] [ -86.8026389 2.2257526 -45.4190996 ] [ -5115.9004803 -25671.5086714 -29261.721102 ] [ 5166.8106893 25674.0908197 29253.4196502 ] [ 86.1499771 -13.8310591 49.647631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.599809944869809e-09 -9.601154767440911e-08 -5.115590176355244e-07 ] [ -8.712127692724465e-08 1.104682409484466e-07 5.180845551583485e-07 ] [ -1.390731586693246e-07 3.566048779404814e-09 -7.276941951690664e-08 ] [ -8.19657614387615e-06 -4.113029101398155e-05 -4.688244543399441e-05 ] [ 8.278143290495993e-06 4.113442807161924e-05 4.686914504200175e-05 ] [ 1.380274791920754e-07 -2.215979953092309e-08 7.954427366630532e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3906.4734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.258860351257087e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.5617785 0.6322669 0.1653904 ] [ 0.3124009 1.1047982 2.3159041 ] [ -0.1778665 2.627895 0.7935539 ] [ 2.0622034 -0.0715073 1.6342371 ] [ 2.2964704 1.4673238 3.2157902 ] [ 1.9361754 2.08143 1.1251439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.617785e-11 6.322669e-11 1.653904e-11 ] [ 3.124009e-11 1.1047982e-10 2.3159041e-10 ] [ -1.778665e-11 2.627895e-10 7.935539000000001e-11 ] [ 2.0622034e-10 -7.15073e-12 1.6342371e-10 ] [ 2.2964704e-10 1.4673238e-10 3.2157902e-10 ] [ 1.9361754e-10 2.08143e-10 1.1251439e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.23e-05 1.46e-05 0.000102 ] [ 0.0001469 -0.0001632 -9.61e-05 ] [ 0.0002002 3.84e-05 0.000162 ] [ -1.83e-05 0.0002602 -6.17e-05 ] [ -0.0002541 0.0001533 -0.000105 ] [ -1.23e-05 -0.0003033 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.981560347584e-14 2.339177866368e-14 1.634220153216e-13 ] [ 2.3535974559552e-13 -2.6147522451456e-13 -1.5396917325888e-13 ] [ 3.2075575948416e-13 6.152358223872e-14 2.595526125696e-13 ] [ -2.931983216064e-14 4.1688635673216e-13 -9.885429750336e-14 ] [ -4.0711307934528e-13 2.4561367596864e-13 -1.68228545184e-13 ] [ -1.970677243584e-14 -4.8594016908864e-13 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }